2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol

C16H34N2O2 — CID 146339568

IUPAC2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol
SMILESCOCC(C)(C)CC(C)(C)CN1CCN(CCO)CC1
InChIInChI=1S/C16H34N2O2/c1-15(2,12-16(3,4)14-20-5)13-18-8-6-17(7-9-18)10-11-19/h19H,6-14H2,1-5H3
InChIKeySUIYMFLBSSRFTG-UHFFFAOYSA-N
MW286.46 g/mol
LogP1.69
Rot. Bonds8

About 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol

2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol (PubChem CID 146339568) has the molecular formula C16H34N2O2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol
PubChem CID146339568
Molecular FormulaC16H34N2O2
Molecular Weight286.46 g/mol
Exact Mass286.26
IUPAC Name2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol
SMILESCOCC(C)(C)CC(C)(C)CN1CCN(CCO)CC1
InChIInChI=1S/C16H34N2O2/c1-15(2,12-16(3,4)14-20-5)13-18-8-6-17(7-9-18)10-11-19/h19H,6-14H2,1-5H3
InChIKeySUIYMFLBSSRFTG-UHFFFAOYSA-N
XLogP1.69
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-3-[4,7,10-tris(2-hydroxyethyl)-1,4,7,10-tetrazacyclododec-1-yl]propan-1-ol
CID 123455408
ethane;1-(5-methoxy-2,4,4-trimethylpentan-2-yl)-4-(4-methoxy-2,2,4-trimethylpentyl)-1,4-diazepane
CID 156867103
2-[4-[2-[4,7-bis(2-hydroxyethyl)-1,4,7-triazonan-1-yl]ethyl]-7-(2-hydroxyethyl)-1,4,7-triazonan-1-yl]ethanol
CID 18512424
methoxymethane;2-pyrrolidin-1-ylethanol
CID 142059876
2-[4-[4-(2,2-difluoro-3-methoxypropoxy)butyl]piperazin-1-yl]ethanol
CID 142367353
methoxyethane;2-pyrrolidin-1-ylethanol
CID 142175082
1-methyl-4-(2,2,4,4-tetramethylpentyl)piperazine
CID 163906125
2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanol;methyl hydrogen carbonate
CID 67621651
fluoro hypofluorite;2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanol
CID 70545422
[1-(3-methoxy-2,2-dimethylpropyl)piperidin-4-yl]methanamine
CID 22236505
2-[7-(carboxymethyl)-4-(2,2-dimethylpropyl)-10-(2-hydroxyethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 155224329
ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium
CID 176984837

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol (CID 146339568) is 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol is COCC(C)(C)CC(C)(C)CN1CCN(CCO)CC1.
What is the InChIKey of 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol?
The InChIKey is SUIYMFLBSSRFTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O2/c1-15(2,12-16(3,4)14-20-5)13-18-8-6-17(7-9-18)10-11-19/h19H,6-14H2,1-5H3.
What are the key properties of 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol?
2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol has a molecular weight of 286.46 g/mol, XLogP of 1.69, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 146339568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).